| CAS Number | 1335041-71-8 |
| Catalog Number | AG007NCW(AGN-PC-0WA809) |
| Chemical Name | 3-Amino-3'-(pyrrolidinocarbonyl)biphenyl |
| IUPAC Name | [3-(3-aminophenyl)phenyl]-pyrrolidin-1-ylmethanone |
| InChI | InChI=1S/C17H18N2O/c18-16-8-4-6-14(12-16)13-5-3-7-15(11-13)17(20)19-9-1-2-10-19/h3-8,11-12H,1-2,9-10,18H2 |
| InChI Key | POEPLCFHMAEHPS-UHFFFAOYSA-N |
| MDL Number | MFCD22375046 |
| Molecular Formula | C17H18N2O |
| Molecular Weight | 266.3376 |
| SMILES | Nc1cccc(c1)c1cccc(c1)C(=O)N1CCCC1 |
| Synonyms | 3-Amino-3'-(pyrrolidinocarbonyl)biphenyl,
1335041-71-8,
ACMC-209bss,
CTK8B0206,
DTXSID60742717,
ANW-19562,
MFCD22375046,
ZINC85476813,
TC-108307,
Z9722,
(3'-Amino[1,1'-biphenyl]-3-yl)(pyrrolidin-1-yl)methanone,
Methanone, (3'-amino[1,1'-biphenyl]-3-yl)-1-pyrrolidinyl-,
C17H18N2O,
3-Amino-3/'-(pyrrolidinocarbonyl)biphenyl,
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| Complexity | 338 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.344g/mol |
| Monoisotopic Mass | 266.142g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number